Product OPENEYE NAME: [1-(3-nitrophenyl)pyrazol-3-yl]-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone
CAS Name: [1-(3-nitrophenyl)-3-pyrazolyl]-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]methanone
IUPAC NAME: [1-(3-nitrophenyl)pyrazol-3-yl]-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone
SYSTEMATIC NAME: [1-(3-nitrophenyl)pyrazol-3-yl]-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methanone
MOLECULAR FORMULA: C21H17F3N6O5
MOLECULAR WEIGHT: 490.39209
SMILES: C1CN(CCN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]
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Product OPENEYE NAME: [4-methyl-2-(5-methyl-2-furyl)thiazol-5-yl]-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]methanone
CAS Name: [4-methyl-2-(5-methyl-2-furanyl)-5-thiazolyl]-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]methanone
IUPAC NAME: [4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone
SYSTEMATIC NAME: [4-methyl-2-(5-methylfuran-2-yl)-1,3-thiazol-5-yl]-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]methanone
MOLECULAR FORMULA: C20H19F3N4O2S
MOLECULAR WEIGHT: 436.45067
SMILES: CC1=CC=C(O1)C2=NC(=C(S2)C(=O)N3CCN(CC3)C4=NC=C(C=C4)C(F)(F)F)C
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Product OPENEYE NAME: diethyl-[(1R)-2-methyl-1-[[(1-methylsulfonylindoline-5-carbonyl)amino]methyl]propyl]ammonium
CAS Name: diethyl-[(2R)-3-methyl-1-[[(1-methylsulfonyl-2,3-dihydroindol-5-yl)-oxomethyl]amino]butan-2-yl]ammonium
IUPAC NAME: diethyl-[(2R)-3-methyl-1-[(1-methylsulfonyl-2,3-dihydroindole-5-carbonyl)amino]butan-2-yl]azanium
SYSTEMATIC NAME: diethyl-[(2R)-3-methyl-1-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonylamino]butan-2-yl]azanium
MOLECULAR FORMULA: C19H32N3O3S+
MOLECULAR WEIGHT: 382.54068
SMILES: CC[NH+](CC)[C@@H](CNC(=O)C1=CC2=C(C=C1)N(CC2)S(=O)(=O)C)C(C)C
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Product OPENEYE NAME: N-[(2R)-2-(diethylamino)-3-methyl-butyl]-1-methylsulfonyl-indoline-5-carboxamide
CAS Name: N-[(2R)-2-(diethylamino)-3-methylbutyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
IUPAC NAME: N-[(2R)-2-(diethylamino)-3-methylbutyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
SYSTEMATIC NAME: N-[(2R)-2-(diethylamino)-3-methyl-butyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
MOLECULAR FORMULA: C19H31N3O3S
MOLECULAR WEIGHT: 381.53274
SMILES: CCN(CC)[C@@H](CNC(=O)C1=CC2=C(C=C1)N(CC2)S(=O)(=O)C)C(C)C
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Product OPENEYE NAME: diethyl-[(1S)-2-methyl-1-[[(1-methylsulfonylindoline-5-carbonyl)amino]methyl]propyl]ammonium
CAS Name: diethyl-[(2S)-3-methyl-1-[[(1-methylsulfonyl-2,3-dihydroindol-5-yl)-oxomethyl]amino]butan-2-yl]ammonium
IUPAC NAME: diethyl-[(2S)-3-methyl-1-[(1-methylsulfonyl-2,3-dihydroindole-5-carbonyl)amino]butan-2-yl]azanium
SYSTEMATIC NAME: diethyl-[(2S)-3-methyl-1-[(1-methylsulfonyl-2,3-dihydroindol-5-yl)carbonylamino]butan-2-yl]azanium
MOLECULAR FORMULA: C19H32N3O3S+
MOLECULAR WEIGHT: 382.54068
SMILES: CC[NH+](CC)[C@H](CNC(=O)C1=CC2=C(C=C1)N(CC2)S(=O)(=O)C)C(C)C
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Product OPENEYE NAME: N-[(2S)-2-(diethylamino)-3-methyl-butyl]-1-methylsulfonyl-indoline-5-carboxamide
CAS Name: N-[(2S)-2-(diethylamino)-3-methylbutyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
IUPAC NAME: N-[(2S)-2-(diethylamino)-3-methylbutyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
SYSTEMATIC NAME: N-[(2S)-2-(diethylamino)-3-methyl-butyl]-1-methylsulfonyl-2,3-dihydroindole-5-carboxamide
MOLECULAR FORMULA: C19H31N3O3S
MOLECULAR WEIGHT: 381.53274
SMILES: CCN(CC)[C@H](CNC(=O)C1=CC2=C(C=C1)N(CC2)S(=O)(=O)C)C(C)C
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Product OPENEYE NAME: ethyl N-[3-oxo-3-[4-[5-(trifluoromethyl)-2-pyridyl]piperazin-1-yl]propyl]carbamate
CAS Name: N-[3-oxo-3-[4-[5-(trifluoromethyl)-2-pyridinyl]-1-piperazinyl]propyl]carbamic acid ethyl ester
IUPAC NAME: ethyl N-[3-oxo-3-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propyl]carbamate
SYSTEMATIC NAME: ethyl N-[3-oxidanylidene-3-[4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl]propyl]carbamate
MOLECULAR FORMULA: C16H21F3N4O3
MOLECULAR WEIGHT: 374.35815
SMILES: CCOC(=O)NCCC(=O)N1CCN(CC1)C2=NC=C(C=C2)C(F)(F)F
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Product OPENEYE NAME: N'-(adamantane-1-carbonyl)-2-(5-methyl-2-furyl)thiazole-4-carbohydrazide
CAS Name: N'-[1-adamantyl(oxo)methyl]-2-(5-methyl-2-furanyl)-4-thiazolecarbohydrazide
IUPAC NAME: N'-(adamantane-1-carbonyl)-2-(5-methylfuran-2-yl)-1,3-thiazole-4-carbohydrazide
SYSTEMATIC NAME: N'-(1-adamantylcarbonyl)-2-(5-methylfuran-2-yl)-1,3-thiazole-4-carbohydrazide
MOLECULAR FORMULA: C20H23N3O3S
MOLECULAR WEIGHT: 385.47992
SMILES: CC1=CC=C(O1)C2=NC(=CS2)C(=O)NNC(=O)C34CC5CC(C3)CC(C5)C4
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Product OPENEYE NAME: [4-[(1R)-1-(2-chlorophenyl)ethyl]piperazin-1-yl]-(2-hydroxy-5-methyl-phenyl)methanone
CAS Name: [4-[(1R)-1-(2-chlorophenyl)ethyl]-1-piperazinyl]-(2-hydroxy-5-methylphenyl)methanone
IUPAC NAME: [4-[(1R)-1-(2-chlorophenyl)ethyl]piperazin-1-yl]-(2-hydroxy-5-methylphenyl)methanone
SYSTEMATIC NAME: [4-[(1R)-1-(2-chlorophenyl)ethyl]piperazin-1-yl]-(5-methyl-2-oxidanyl-phenyl)methanone
MOLECULAR FORMULA: C20H23ClN2O2
MOLECULAR WEIGHT: 358.86182
SMILES: CC1=CC(=C(C=C1)O)C(=O)N2CCN(CC2)[C@H](C)C3=CC=CC=C3Cl
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Product OPENEYE NAME: [4-[(1S)-1-(2-chlorophenyl)ethyl]piperazin-1-yl]-(2-hydroxy-5-methyl-phenyl)methanone
CAS Name: [4-[(1S)-1-(2-chlorophenyl)ethyl]-1-piperazinyl]-(2-hydroxy-5-methylphenyl)methanone
IUPAC NAME: [4-[(1S)-1-(2-chlorophenyl)ethyl]piperazin-1-yl]-(2-hydroxy-5-methylphenyl)methanone
SYSTEMATIC NAME: [4-[(1S)-1-(2-chlorophenyl)ethyl]piperazin-1-yl]-(5-methyl-2-oxidanyl-phenyl)methanone
MOLECULAR FORMULA: C20H23ClN2O2
MOLECULAR WEIGHT: 358.86182
SMILES: CC1=CC(=C(C=C1)O)C(=O)N2CCN(CC2)[C@@H](C)C3=CC=CC=C3Cl
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Product OPENEYE NAME: (4-benzyl-1-piperidyl)-[3-(p-tolyl)isoxazol-5-yl]methanone
CAS Name: [3-(4-methylphenyl)-5-isoxazolyl]-[4-(phenylmethyl)-1-piperidinyl]methanone
IUPAC NAME: (4-benzylpiperidin-1-yl)-[3-(4-methylphenyl)-1,2-oxazol-5-yl]methanone
SYSTEMATIC NAME: [3-(4-methylphenyl)-1,2-oxazol-5-yl]-[4-(phenylmethyl)piperidin-1-yl]methanone
MOLECULAR FORMULA: C23H24N2O2
MOLECULAR WEIGHT: 360.44886
SMILES: CC1=CC=C(C=C1)C2=NOC(=C2)C(=O)N3CCC(CC3)CC4=CC=CC=C4
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Product OPENEYE NAME: 3-bromo-4-[2-[(3S,5R)-3,5-dimethyl-1-piperidyl]-2-oxo-ethoxy]-5-ethoxy-benzonitrile
CAS Name: 3-bromo-4-[2-[(3S,5R)-3,5-dimethyl-1-piperidinyl]-2-oxoethoxy]-5-ethoxybenzonitrile
IUPAC NAME: 3-bromo-4-[2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethoxy]-5-ethoxybenzonitrile
SYSTEMATIC NAME: 3-bromanyl-4-[2-[(3S,5R)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethoxy]-5-ethoxy-benzenecarbonitrile
MOLECULAR FORMULA: C18H23BrN2O3
MOLECULAR WEIGHT: 395.29082
SMILES: CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)N2C[C@@H](C[C@@H](C2)C)C
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Product OPENEYE NAME: 3-bromo-4-[2-[(3R,5R)-3,5-dimethyl-1-piperidyl]-2-oxo-ethoxy]-5-ethoxy-benzonitrile
CAS Name: 3-bromo-4-[2-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-2-oxoethoxy]-5-ethoxybenzonitrile
IUPAC NAME: 3-bromo-4-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxoethoxy]-5-ethoxybenzonitrile
SYSTEMATIC NAME: 3-bromanyl-4-[2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethoxy]-5-ethoxy-benzenecarbonitrile
MOLECULAR FORMULA: C18H23BrN2O3
MOLECULAR WEIGHT: 395.29082
SMILES: CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)N2C[C@@H](C[C@H](C2)C)C
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Product OPENEYE NAME: 3-bromo-4-[2-[(3S,5S)-3,5-dimethyl-1-piperidyl]-2-oxo-ethoxy]-5-ethoxy-benzonitrile
CAS Name: 3-bromo-4-[2-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-2-oxoethoxy]-5-ethoxybenzonitrile
IUPAC NAME: 3-bromo-4-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-oxoethoxy]-5-ethoxybenzonitrile
SYSTEMATIC NAME: 3-bromanyl-4-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-oxidanylidene-ethoxy]-5-ethoxy-benzenecarbonitrile
MOLECULAR FORMULA: C18H23BrN2O3
MOLECULAR WEIGHT: 395.29082
SMILES: CCOC1=C(C(=CC(=C1)C#N)Br)OCC(=O)N2C[C@H](C[C@@H](C2)C)C
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Product OPENEYE NAME: 4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-(2-pyridylmethyl)butanamide
CAS Name: 4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-(2-pyridinylmethyl)butanamide
IUPAC NAME: 4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-(pyridin-2-ylmethyl)butanamide
SYSTEMATIC NAME: 4-(3-tert-butyl-1,2,4-oxadiazol-5-yl)-N-(pyridin-2-ylmethyl)butanamide
MOLECULAR FORMULA: C16H22N4O2
MOLECULAR WEIGHT: 302.37148
SMILES: CC(C)(C)C1=NOC(=N1)CCCC(=O)NCC2=CC=CC=N2
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Product OPENEYE NAME: 5-(4-bromophenyl)-N-(2-pyridylmethyl)thiophene-2-carboxamide
CAS Name: 5-(4-bromophenyl)-N-(2-pyridinylmethyl)-2-thiophenecarboxamide
IUPAC NAME: 5-(4-bromophenyl)-N-(pyridin-2-ylmethyl)thiophene-2-carboxamide
SYSTEMATIC NAME: 5-(4-bromophenyl)-N-(pyridin-2-ylmethyl)thiophene-2-carboxamide
MOLECULAR FORMULA: C17H13BrN2OS
MOLECULAR WEIGHT: 373.26692
SMILES: C1=CC=NC(=C1)CNC(=O)C2=CC=C(S2)C3=CC=C(C=C3)Br
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